1,5-dimethylpyrazole-3-carboxylic acid, ethyl ester
Compound with spectra: 8 NMR, 1 FTIR, 1 UV-Vis, and 1 MS (GC)
| SpectraBase Compound ID | 8DSfVMBcA0x |
|---|---|
| InChI | InChI=1S/C8H12N2O2/c1-4-12-8(11)7-5-6(2)10(3)9-7/h5H,4H2,1-3H3 |
| InChIKey | OJPXVXXMBWKEAT-UHFFFAOYSA-N |
| Mol Weight | 168.2 g/mol |
| Molecular Formula | C8H12N2O2 |
| Exact Mass | 168.089878 g/mol |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | SOLID |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | C. L. Habraken, University of Leiden, Leiden, the Netherlands |
| Technique | CAPILLARY CELL: MELT |
| Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | Methanol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | Y-36-218-2 |
- OJPXVXXMBWKEAT-UHFFFAOYSA-N
- 5-METHYL-N-METHYLPYRAZOL-3-CARBONSAEURE-ETHYLESTER
- 1,5-DIMETHYL-3-ETHOXYCARBONYL-PYRAZOLE
- PYRAZOLE-3-CARBOXYLIC ACID, 1,5- DIMETHYL-, ETHYL ESTER
- Ethyl 1,5-dimethylpyrazole-3-carboxylate
- 1,5-Dimethyl-3-pyrazolecarboxylic acid, ethyl ester
- 1H-PYRAZOLE-3-CARBOXYLIC ACID, 1,5-DIMETHYL- ETHYL ESTER
3-Ethoxymethyl-1H-pyrazole-5-carboxyethyl ester
Ethyl 5-n-propyl-1H-pyrazole-3-carboxylate
BUPJQRZXFNJFHG-UHFFFAOYSA-N
methyl 3-(trifluoromethyl)-1H-pyrazole-5-carboxylate
METHYL-3-HEXYL-1H-PYRAZOLE-5-CARBOXYLATE
METHYL-3-HEPTYL-1H-PYRAZOLE-5-CARBOXYLATE
1H-Pyrazole-3,5-dicarboxylic acid, 4-hydroxy-, dimethyl ester
4-Chloro-2-methyl-2H-pyrazole-3-carboxylic acid methyl ester
NJUXFNQDUIJYPO-UHFFFAOYSA-N
1H-pyrazole-1-propanoic acid, 3-carboxy-
| Title | Journal or Book | Year |
|---|---|---|
| Packing Modes in Eight 3-Ethoxycarbonylpyrazole Derivatives. Influence of the Substituents on the Crystal Structure and Annular Tautomerism | HETEROCYCLES | 1999 |
| Substituent effects on the15N NMR Parameters of Azoles | Magnetic Resonance in Chemistry | 1997 |
| 13C NMR of pyrazoles | Magnetic Resonance in Chemistry | 1993 |
| 13C NMR chemical shifts ofN-unsubstituted- andN-methyl-pyrazole derivatives | Organic Magnetic Resonance | 1984 |
This compound is available in the following databases:
KnowItAll NMR Spectral Library
Author: Wiley
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